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U2H

Summary
Name:~{N}-methyl-~{N}-[(5-phenylmethoxy-1~{H}-indol-3-yl)methyl]propan-1-amine
Formula:C20 H24 N2 O
Formal charge:0
Formula weight:308.417 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-methyl-~{N}-[(5-phenylmethoxy-1~{H}-indol-3-yl)methyl]propan-1-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C20H24N2O/c1-3-11-22(2)14-17-13-21-20-10-9-18(12-19(17)20)23-15-16-7-5-4-6-8-16/h4-10,12-13,21H,3,11,14-15H2,1-2H3
InChIKeyInChI1.06IWUWPBUWKVJQPU-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCN(C)Cc1c[nH]c2ccc(OCc3ccccc3)cc12
SMILESCACTVS3.385CCCN(C)Cc1c[nH]c2ccc(OCc3ccccc3)cc12
SMILES_CANONICALOpenEye OEToolkits2.0.7CCCN(C)Cc1c[nH]c2c1cc(cc2)OCc3ccccc3
SMILESOpenEye OEToolkits2.0.7CCCN(C)Cc1c[nH]c2c1cc(cc2)OCc3ccccc3

218853

PDB entries from 2024-04-24

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